Chemical Properties of Naphthalene, 5-butyl-1,2,3,4-tetrahydro- (CAS 66325-42-6)

InChI

InChI=1S/C14H20/c1-2-3-7-12-9-6-10-13-8-4-5-11-14(12)13/h6,9-10H,2-5,7-8,11H2,1H3

InChI Key

HLZHYZXDXDQGEB-UHFFFAOYSA-N

Formula

C14H20

SMILES

CCCCc1cccc2c1CCCC2

Molecular Weight¹

188.31

CAS

66325-42-6

Other Names

• 5-Butyl-tetralin

• ω : Acentric Factor.
• Δ_cH°_liquid : Standard liquid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.4985		Relay (1.0) Calculated Property
ΔcH°liquid	-7782.00	kJ/mol	NIST
ΔfusH°	20.24	kJ/mol	Joback Calculated Property
IE	8.42	eV	Relay (1.0) Calculated Property
logPoct/wat	3.908		Crippen Calculated Property
McVol	173.500	ml/mol	McGowan Calculated Property
Pc	2327.03	kPa	Joback Calculated Property
Inp	[1536.00; 1536.00]
Inp	1536.00		NIST
Inp	1536.00		NIST
Tboil	[553.06; 553.06]	K
Tboil	553.06 ± 0.30	K	NIST
Tboil	553.06 ± 0.30	K	NIST
Tc	766.09	K	Relay (1.0) Calculated Property
Tfus	[224.00; 224.00]	K
Tfus	224.00 ± 2.00	K	NIST
Tfus	224.00 ± 2.00	K	NIST
Vc	0.653	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[429.38; 526.89]	J/mol×K	[572.04; 789.82]
Cp,gas	429.38	J/mol×K	572.04	Joback Calculated Property
Cp,gas	448.35	J/mol×K	608.34	Joback Calculated Property
Cp,gas	466.15	J/mol×K	644.63	Joback Calculated Property
Cp,gas	482.84	J/mol×K	680.93	Joback Calculated Property
Cp,gas	498.48	J/mol×K	717.22	Joback Calculated Property
Cp,gas	513.14	J/mol×K	753.52	Joback Calculated Property
Cp,gas	526.89	J/mol×K	789.82	Joback Calculated Property
η	[0.0002716; 0.0022322]	Pa×s	[317.66; 572.04]
η	0.0022322	Pa×s	317.66	Joback Calculated Property
η	0.0012779	Pa×s	360.06	Joback Calculated Property
η	0.0008228	Pa×s	402.45	Joback Calculated Property
η	0.0005761	Pa×s	444.85	Joback Calculated Property
η	0.0004292	Pa×s	487.25	Joback Calculated Property
η	0.0003352	Pa×s	529.64	Joback Calculated Property
η	0.0002716	Pa×s	572.04	Joback Calculated Property

Similar Compounds

Find more compounds similar to Naphthalene, 5-butyl-1,2,3,4-tetrahydro-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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